Vitas-M small molecule compound
(4E)-4-{[(2,4-dimethyl-6-nitrophenyl)amino]methylidene}-5-methyl-2-(4-methylphenyl)-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK751265
SMILES Cc1ccc(cc1)N1N=C(/C(=C\Nc2c(C)cc(cc2[N+](=O)[O-])C)/C1=O)C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C20H20N4O3 MW 364.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N4O3/c1-12-5-7-16(8-6-12)23-20(25)17(15(4)22-23)11-21-19-14(3)9-13(2)10-18(19)24(26)27/h5-11,21H,1-4H3/b17-11+InChIKey
OUZZSTIIRRBJDF-GZTJUZNOSA-NSynonyms
(4E)4(((24dimethyl6nitrophenyl)amino)methylidene)5methyl2(4methylphenyl)24dihydro3Hpyrazol3one
(4E)4((24DIMETHYL6NITROANILINO)METHYLIDENE)5METHYL2(4METHYLPHENYL)PYRAZOL3ONE
CC1=CC=C(C=C1)N2C(=O)C(=CNC3=C(C=C(C=C3(N+)(=O)(O))C)C)C(=N2)C
Cc1ccc(cc1)N1N=C(C(=CNc2c(C)cc(cc2(N+)(=O)(O))C)C1=O)C
InChI=1SC20H20N4O3c1125716(8612)2320(25)17(15(4)2223)11211914(3)913(2)1018(19)24(26)27h51121H14H3b1711+
MFCD00746770
ZINC000004359118
ZINC04359118
ZINC4359118
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